Related Issues (20)
- Can we use pretrain model (mace_mp) and retrain with our configurations? HOT 2
- Multi-GPU evaluation for optimisation of a full protein structure HOT 1
- checkpoint file not read in foundation branch. HOT 7
- Error while using foundation branch HOT 8
- Update install instructions for conda-forge HOT 5
- loss function evaluated as zero. HOT 2
- Setting `dispersion=True` in the MACE-MP-0 foundation model omits data from `calc.results` HOT 1
- LAMMPS-MACE with Kokkos: Illegal memory access encountered with trained MACE but works with MP-MACE-0 HOT 51
- multi-gpu lammps issue HOT 6
- Fine-tunning up-to-date MACE-MP-0 model HOT 7
- Don't modify torch default dtype HOT 1
- typo? in multi-gpu branch run_train.py
- repulsion branch DistributedEnvironment exception produces no output HOT 1
- Where are the Similarity Statement Files for Mace-mp-0? HOT 1
- How to repeat the test-result in your paper
- Possibility to not compute energies on `MACE.forward` HOT 1
- run_train.py crashes if swa fails to make progress HOT 2
- RMSE increases when training on multi-gpu HOT 1
- questions about mace documentation HOT 6
- How to add two MACE models in `mace-md`? HOT 1
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from mace.